2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole-5-carbaldehyde

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole-5-carbaldehyde Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)thiazole-5-carbaldehyde CAS Name: 2-(4-methyl-1-piperazin-4-iumyl)-5-thiazolecarboxaldehyde IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)-1,3-thiazole-5-carbaldehyde Traditional Name: 2-(4-methylpiperazin-4-ium-1-yl)thiazole-5-carbaldehyde Formula: C9H14N3OS+ MolecularWeight: 212.29196

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(S2)C=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(S2)C=O

InChI

InChI=1S/C9H13N3OS/c1-11-2-4-12(5-3-11)9-10-6-8(7-13)14-9/h6-7H,2-5H2,1H3/p+1